MMs00029708 MOE2007 2D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0017 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 -1.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4971 -2.5997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 -3.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 -3.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4971 -2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 -1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9971 -2.6048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7457 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9942 -5.2028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2457 -3.9063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -5.2062 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8351 -5.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3826 -6.5758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4962 -7.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7960 -6.8322 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4858 -5.3646 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1752 -4.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4908 -4.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0288 -2.8239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9576 -4.5645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9626 -3.4509 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2731 -4.6100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5006 -2.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5056 -0.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0436 0.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0486 1.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5154 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9774 -0.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9724 -1.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4294 -3.7644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4344 -2.6508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8914 -5.1915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1657 -7.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3802 -6.5635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3208 -8.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6905 -9.5474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8456 -11.0394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6311 -11.9197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2614 -11.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1063 -9.8161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0013 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0013 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2971 -2.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6445 -4.9382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3445 -4.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3497 -0.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5983 -1.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8468 -2.8677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 -5.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6762 -7.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6035 -8.3827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2004 -8.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3272 -5.7062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4405 -2.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7629 -1.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8701 0.7677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6790 2.7721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3194 2.2078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1509 -0.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1572 -1.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0874 -6.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0649 -5.4423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6621 -8.8432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7552 -13.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2898 -12.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 6 7 2 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 32 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 66 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 40 67 1 0 0 0 0 41 42 1 0 0 0 0 41 68 1 0 0 0 0 M END